methyl 4,5-dimethyl-2-[2-[(2-piperidin-1-ylphenyl)amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4,5-dimethyl-2-[2-[(2-piperidin-1-ylphenyl)amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-[2-(1-piperidyl)anilino]acetyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[1-oxo-2-[2-(1-piperidinyl)anilino]ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4,5-dimethyl-2-[[2-(2-piperidin-1-ylanilino)acetyl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-(2-piperidinoanilino)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CNC2=CC=CC=C2N3CCCCC3)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CNC2=CC=CC=C2N3CCCCC3)C

InChI

InChI=1S/C21H27N3O3S/c1-14-15(2)28-20(19(14)21(26)27-3)23-18(25)13-22-16-9-5-6-10-17(16)24-11-7-4-8-12-24/h5-6,9-10,22H,4,7-8,11-13H2,1-3H3,(H,23,25)